| SpectraBase Spectrum ID |
26KRtIEqdbd |
| Name |
3-(2-(2-bromo-4,5-dimethoxyphenyl)-2-(4-(trifluoromethoxy)phenyl)ethyl)benzonitrile |
| Appearance |
Waxy oil |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
505.050040962 u |
| Formula |
C24H19BrF3NO3 |
| InChI |
InChI=1S/C24H19BrF3NO3/c1-30-22-12-20(21(25)13-23(22)31-2)19(11-15-4-3-5-16(10-15)14-29)17-6-8-18(9-7-17)32-24(26,27)28/h3-10,12-13,19H,11H2,1-2H3 |
| InChIKey |
INCGXVPXLIAPSS-UHFFFAOYSA-N |
| Instrument Name |
FINNIGAN MAT 95Q |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202101682 |
| Molecular Weight |
506.319 g/mol |
| Reported Formula |
C24H19BrF3NO3 |
| SMILES |
C=1(C(CC2=CC(=CC=C2)C#N)C=2C=CC(=CC2)OC(F)(F)F)C=C(C(=CC1Br)OC)OC |
| SPLASH |
splash10-01p9-0159000000-52df685286c2c9ab9120 |
| Source of Spectrum |
ACI-60-SM36-6j (DOI: 10.1002/anie.202101682) |
| Wiley ID |
1891280 |
